![N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide structure](/static/products/1650/165058-96-8.webp)
N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide
TL;DR: N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide (CAS 165058-96-8) is a chemical compound with molecular formula C14H12Cl3N3O2 and molecular weight 359.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide
Also Known As: BAS 00104577, N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide, N-(2,2,2-Trichloro-1-(4-methyl-6-oxopyrimidin-1(6H)-yl)ethyl)benzamide, phenyl-N-[2,2,2-trichloro-1-(4-methyl-6-oxohydropyrimidinyl)ethyl]carboxamide, N-(2,2,2-TRICHLORO-1-(4-METHYL-6-OXO-1(6H)-PYRIMIDINYL)ETHYL)BENZAMIDE
| Molecular Formula | C14H12Cl3N3O2 |
|---|---|
| Molecular Weight | 359.00 g/mol |
| LogP | 2.85052 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.9995 |
| Heavy Atoms | 22 |
| Complexity | 726.1032 |
Chemical Identifiers
| CAS Number | 165058-96-8 |
|---|---|
| SMILES | CC1=CC(=O)N(C=N1)C(C(Cl)(Cl)Cl)NC(=O)C2=CC=CC=C2 |
Product Overview
N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide (CAS 165058-96-8), with molecular formula C14H12Cl3N3O2 and molecular weight 359.00 g/mol. IUPAC: N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide.
Chemical Property Profile of N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide
Property Insights of N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide
The XLogP value of 2.85052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide. Following Lipinski's Rule of Five, N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide?
The CAS number of N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide is 165058-96-8.
What is the molecular formula of N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide?
The molecular formula of N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide is C14H12Cl3N3O2.
What is the molecular weight of N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide?
The molecular weight of N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide is 359.00 g/mol.
Where can I buy N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide?
You can request a quote for N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2,2,2-trichloro-1-(4-methyl-6-oxopyrimidin-1-yl)ethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.